기본 정보
- CAS
16521-38-3- 표준 SMILES
O=C1C(c2[nH]c3ccc(S(=O)(=O)O)cc3c2O)=Nc2ccc(S(=O)(=O)O)cc21.[Al+3]- InChIKey
KHLVKKOJDHCJMG-HLBFIJABSA-L- 분자식
- C16H10AlN2O8S2+3
- 평균 분자량
- 449.4 g/mol
- 단동위원소 질량
- 448.969396
개요
C.I. Pigment Blue 63 is a member of hydroxyindoles.
이름 및 식별자
- 우선 이름
- C.I. Pigment Blue 63
- IUPAC
- aluminum 2-(3-hydroxy-5-sulfo-1H-indol-2-yl)-3-oxoindole-5-sulfonic acid
- 영어명
- Food Blue 1:1
- 분자식
- C16H8N2O8S2.2Na
- 분자량
- 466.357
이름 및 동의어
16521-38-3RefChem:572495DTXSID6044224C.I. Food Blue 1-aluminum lake1342-11-6Certolake indigo carmineIndigotine-aluminum lakealuminum;2-(3-hydroxy-5-sulfo-1H-indol-2-yl)-3-oxoindole-5-sulfonic acidC.I. Food Blue 1:1Indigo carmine-aluminum lakeJapan Blue 2 Aluminum lakeAcid Blue 74-aluminum lake
이름 더 보기
Blue 1 LakeAO2Blue 2 LakeC.I. 73015:1Food Blue 1:1Pigment Blue 63FD&C BLUE 2 LAKEC.I. Pigment Blue 63
Japan Food Blue No. 2 aluminum lakeC.I. 73015 Aluminum lakeC.I. 73015-Aluminum lakeFood Blue No. 2-aluminum lakeC.I. Acid Blue 74-aluminum lakeEINECS 240-589-3Indigo disulfonic acid, aluminum saltFD&C Blue No. 2-aluminum lake
데이터베이스 식별자
- CAS
16521-38-3- PubChem CID
- 61842
- ChEBI
CHEBI:172686
물성
구조 계산 물성
- 극성 표면적
- 191 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 29
- 형식 전하
- 3
- 복잡도
- 904
실험 및 물리화학적 성질
Food Additives
Devices -> FDA Regulatory Status of Color Additives
COLOR OR COLORING ADJUNCT -> FDA Substance added to food
Food Contact SubstancesFCS -> FDA Cumulative Estimated Daily Intake (CEDI)
Physical DescriptionOther Solid
물리화학적 성질
- 밀도
- 1.603 · 1.603[at 20℃]
- 증기압
- 0 Pa · 0Pa at 25℃
- 화장품 원료 기능
- 머리 염색
- LogP
- -3.57 · -3.57
- EPA
- 63 · C.I. Pigment Blue 63 (16521-38-3)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (159 of 159) of all reports.
Not Classified
Aggregated GHS information provided per 159 reports by companies from 1 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: C.I. Pigment Blue 63
C.I. Pigment Blue 63 is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of C.I. Pigment Blue 63 are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
REACH registered substance: Aluminium, 2-(1,3-dihydro-3-oxo-5-sulfo-2H-indol-2-ylidene)-2,3-dihydro-3-oxo-1H-indole-5-sulfonic acid complex (EC: 240-589-3)
C.I. Pigment Blue 63: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesNot Classified
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
U.S. Production2023: 814,000 lb
Consumer UsesPigment
General Manufacturing InformationC.I. Pigment Blue 63: ACTIVE
제조 방법
with strong sulfuric acid or low concentration fuming sulfuric acid sulphonated 3H-indol-3-one,2-(1,3-dihydro-3-oxo-2H-indol-2-ylidene)-1,2-dihydro-, and then into aluminum salt deposit color.
상·하류 제품 정보
상류 원료
하류 제품
관련 반응
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